Chem
J-GLOBAL ID:201407072881740894
Nikkaji number:J3.286.161J
1-[(R)-α-Methylbenzyl]-2-ethyl-4-(4-fluorophenyl)-1H-pyrrole-3-carboxylic acid methyl ester
1-[(R)-α-メチルベンジル]-2-エチル-4-(4-フルオロフェニル)-1H-ピロール-3-カルボン酸メチル
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C22 H22 FNO2
Molecular formula furigana:
C22-H22-F-N-O2
Molecular weight:
351.421
InChI:
InChI=1S/C22H22FNO2/c1-4-20-21(22(25)26-3)19(17-10-12-18(23)13-11-17)14-24(20)15(2)16-8-6-5-7-9-16/h5-15H,4H2,1-3H3/t15-/m1/s1
InChI key:
MDADBMDIXQEDLV-OAHLLOKOSA-N
SMILES:
CCc1c(C(=O)OC)c(cn1[C@H](C)c1ccccc1)c1ccc(F)cc1
Systematic name (3):
1-[(R)-α-メチルベンジル]-2-エチル-4-(4-フルオロフェニル)-1H-ピロール-3-カルボン酸メチル
メチル 2-エチル-4-(4-フルオロフェニル)-1-[(1R)-1-フェニルエチル]-1H-ピロール-3-カルボキシラート
methyl 2-ethyl-4-(4-fluorophenyl)-1-[(1R)-1-phenylethyl]-1H-pyrrole-3-carboxylate
Other name (1):
1-[(R)-α-Methylbenzyl]-2-ethyl-4-(4-fluorophenyl)-1H-pyrrole-3-carboxylic acid methyl ester
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